[2-(methoxymethoxy)phenyl]methanol

C9H12O3 — CID 10920904

IUPAC[2-(methoxymethoxy)phenyl]methanol
SMILESCOCOc1ccccc1CO
InChIInChI=1S/C9H12O3/c1-11-7-12-9-5-3-2-4-8(9)6-10/h2-5,10H,6-7H2,1H3
InChIKeySGNFJKVRXWNJGY-UHFFFAOYSA-N
MW168.19 g/mol
LogP1.16
Rot. Bonds4

About [2-(methoxymethoxy)phenyl]methanol

[2-(methoxymethoxy)phenyl]methanol (PubChem CID 10920904) has the molecular formula C9H12O3 and a molecular weight of 168.19 g/mol. Its IUPAC name is [2-(methoxymethoxy)phenyl]methanol.

Molecular Properties

Compound Name[2-(methoxymethoxy)phenyl]methanol
PubChem CID10920904
Molecular FormulaC9H12O3
Molecular Weight168.19 g/mol
Exact Mass168.08
IUPAC Name[2-(methoxymethoxy)phenyl]methanol
SMILESCOCOc1ccccc1CO
InChIInChI=1S/C9H12O3/c1-11-7-12-9-5-3-2-4-8(9)6-10/h2-5,10H,6-7H2,1H3
InChIKeySGNFJKVRXWNJGY-UHFFFAOYSA-N
XLogP1.16
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.19
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [2-(methoxymethoxy)phenyl]methanol?
The IUPAC name of [2-(methoxymethoxy)phenyl]methanol (CID 10920904) is [2-(methoxymethoxy)phenyl]methanol.
What is the SMILES notation for [2-(methoxymethoxy)phenyl]methanol?
The canonical SMILES for [2-(methoxymethoxy)phenyl]methanol is COCOc1ccccc1CO.
What is the InChIKey of [2-(methoxymethoxy)phenyl]methanol?
The InChIKey is SGNFJKVRXWNJGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12O3/c1-11-7-12-9-5-3-2-4-8(9)6-10/h2-5,10H,6-7H2,1H3.
What are the key properties of [2-(methoxymethoxy)phenyl]methanol?
[2-(methoxymethoxy)phenyl]methanol has a molecular weight of 168.19 g/mol, XLogP of 1.16, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(methoxymethoxy)phenyl]methanol is sourced from PubChem (CID 10920904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).